SCHEMBL1095684

SCHEMBL1095684

Cc1nc2c(C)cccc2c(=O)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 15/20 1.00
KDM4E B2RXH2 2/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54
PARP1 P09874 3/20 0.50
TNKS O95271 2/20 0.44
TNKS2 Q9H2K2 2/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6025899 0.82 ELANE (0.70) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL4116511 0.82 ELANE (0.70) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL28924723 0.82 ELANE (0.70) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL16296659 0.81 ELANE (0.68) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL13206697 0.80 ELANE (0.66) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL1096064 0.80 ELANE (0.66) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL20463303 0.80 ELANE (0.66) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL26438949 0.80 ELANE (0.66) ELANEKDM4EPARP1TNKSTNKS2
SCHEMBL20423396 0.78 ELANE (0.64) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL527226 0.78 ELANE (0.64) ELANEKDM4EMEN1ALDH1A1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115677803-B Preparation method of glycoside derivative containing quinazoline structure and composition thereof and application of glycoside derivative and composition for preventing and treating kiwi fruit canker 贵州理工学院 2025-03-28 CN disclosed
CN-115636795-B Preparation method of quinazolinone derivative containing thiobenzamide structure and composition thereof, and application of quinazolinone derivative and composition thereof in preventing and treating kiwi fruit canker 贵州理工学院 2024-04-05 CN disclosed
CN-115521262-B Preparation method of quinazolinone containing phenyl and composition thereof, and application of quinazolinone and composition in resisting kiwi fruit canker 贵州理工学院 2024-04-05 CN disclosed
CN-115521261-B Preparation method of mercapto-containing quinazolinone and composition thereof, and application of mercapto-containing quinazolinone in resisting kiwi fruit canker 贵州理工学院 2024-04-05 CN disclosed
CN-115677803-A Preparation method of glucoside derivative containing quinazoline structure, preparation method of composition of glucoside derivative and application of composition in prevention and treatment of kiwifruit canker 贵州理工学院 2023-02-03 CN disclosed
CN-115636795-A Quinazolinone derivative containing thiobenzamide structure, composition and application of quinazolinone derivative in prevention and treatment of kiwifruit canker 贵州理工学院 2023-01-24 CN disclosed
CN-115521262-A Preparation method of phenyl-containing quinazolinone and composition thereof and application of phenyl-containing quinazolinone in resisting kiwifruit canker 贵州理工学院 2022-12-27 CN disclosed
CN-115521261-A Preparation method of sulfhydryl-containing quinazolinone and composition thereof and application of sulfhydryl-containing quinazolinone in resisting kiwifruit canker 贵州理工学院 2022-12-27 CN disclosed
US-9242941-B2 Alkyl, fluoroalkyl-1,4-benzodiazepinone compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2016-01-26 US disclosed
US-20150239851-A1 ALKYL, FLUOROALKYL-1,4-BENZODIAZEPINONE COMPOUNDS BRISTOL-METERS SQUIBB COMPANY (US) 2015-08-27 US disclosed
US-8580968-B2 Benzothiazole and benzooxazole derivatives and methods of use ABBVIE INC. (US) 2013-11-12 US disclosed
US-20120164070-A1 BENZOTHIAZOLE AND BENZOOXAZOLE DERIVATIVES AND METHODS OF USE ABBOTT LABORATORIES (US) 2012-06-28 US disclosed
US-8153813-B2 Benzothiazole and benzooxazole derivatives and methods of use ABBOTT LABORATORIES (US) 2012-04-10 US disclosed
US-20090163464-A1 BENZOTHIAZOLE AND BENZOOXAZOLE DERIVATIVES AND METHODS OF USE ABBOTT LABORATORIES (US) 2009-06-25 US disclosed
US-20060229324-A1 Quinazolin-4-one derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2006-10-12 US disclosed
EP-0347831-B1 Pyridine derivatives and intermediates thereof KYOWA HAKKO KOGYO KK (JP) 1996-12-11 EP disclosed
US-4971964-A INHIBITORS OF THROMBOXANE SYNTHASE, CARDIOVASCULAR DISORDERS, ANTIINFLAMMATORU AGENTS, CANCER KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-11-20 US disclosed
EP-0347831-A2 Pyridine derivatives and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1989-12-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060229324-A1 Quinazolin-4-one derivatives HPGDS, PTGS1, PTGDR ELANE 1046/4885KDM4E 3855/4885MEN1 3991/4885
US-20150239851-A1 ALKYL, FLUOROALKYL-1,4-BENZODIAZEPINONE COMPOUNDS CNR1, CNR2, NR1I3 ELANE 4756/4885KDM4E 306/4885MEN1 1197/4885
US-20120164070-A1 BENZOTHIAZOLE AND BENZOOXAZOLE DERIVATIVES AND METHODS OF USE HRH2, HRH1, HRH4 ELANE 1012/4885KDM4E 2024/4885MEN1 2933/4885
US-20090163464-A1 BENZOTHIAZOLE AND BENZOOXAZOLE DERIVATIVES AND METHODS OF USE HRH2, HRH1, HRH4 ELANE 1012/4885KDM4E 2024/4885MEN1 2933/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.